methanesulfonic acid; 4-methoxy-3-[2-(methylamino)-1-oxidanyl-ethyl]benzenesulfonamide

Systemtic Name: methanesulfonic acid; 4-methoxy-3-[2-(methylamino)-1-oxidanyl-ethyl]benzenesulfonamide Openeye Name: 3-[1-hydroxy-2-(methylamino)ethyl]-4-methoxy-benzenesulfonamide; methanesulfonic acid CAS Name: 3-[1-hydroxy-2-(methylamino)ethyl]-4-methoxybenzenesulfonamide; methanesulfonic acid IUPAC Name: 3-[1-hydroxy-2-(methylamino)ethyl]-4-methoxybenzenesulfonamide; methanesulfonic acid Traditional Name: 3-[1-hydroxy-2-(methylamino)ethyl]-4-methoxy-benzenesulfonamide; mesylic acid Formula: C11H20N2O7S2 MolecularWeight: 356.4157

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Descriptors Computed from Structure

Canonical SMILES:

CNCC(C1=C(C=CC(=C1)S(=O)(=O)N)OC)O.CS(=O)(=O)O

Isomeric SMILES

CNCC(C1=C(C=CC(=C1)S(=O)(=O)N)OC)O.CS(=O)(=O)O

InChI

InChI=1S/C10H16N2O4S.CH4O3S/c1-12-6-9(13)8-5-7(17(11,14)15)3-4-10(8)16-2;1-5(2,3)4/h3-5,9,12-13H,6H2,1-2H3,(H2,11,14,15);1H3,(H,2,3,4)